5,7,8,4'-Tetrahydroxy-3-methoxyflavone
TL;DR: 5,7,8,4'-Tetrahydroxy-3-methoxyflavone (CAS 86749-50-0) is a chemical compound with molecular formula C16H12O7 and molecular weight 316.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,7,8-trihydroxy-2-(4-hydroxyphenyl)-3-methoxychromen-4-one
Also Known As: 3-Methylherbacetin, 3-Methoxyherbacetin, 5,7,8,4'-Tetrahydroxy-3-methoxyflavone, 5,7,8-trihydroxy-2-(4-hydroxyphenyl)-3-methoxychromen-4-one, RefChem:1072233
| Molecular Formula | C16H12O7 |
|---|---|
| Molecular Weight | 316.06 g/mol |
| LogP | 2.291 |
| Topological Polar Surface Area | 120.36 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 316.0583 |
| Heavy Atoms | 23 |
| Complexity | 955.0552 |
Chemical Identifiers
| CAS Number | 86749-50-0 |
|---|---|
| SMILES | COC1=C(OC2=C(C1=O)C(=CC(=C2O)O)O)C3=CC=C(C=C3)O |
Product Overview
5,7,8,4'-Tetrahydroxy-3-methoxyflavone (CAS 86749-50-0), with molecular formula C16H12O7 and molecular weight 316.06 g/mol. IUPAC: 5,7,8-trihydroxy-2-(4-hydroxyphenyl)-3-methoxychromen-4-one.
Chemical Property Profile of 5,7,8,4'-Tetrahydroxy-3-methoxyflavone
Property Insights of 5,7,8,4'-Tetrahydroxy-3-methoxyflavone
The XLogP value of 2.291 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,7,8,4'-Tetrahydroxy-3-methoxyflavone. The TPSA of 120.36 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,7,8,4'-Tetrahydroxy-3-methoxyflavone. Following Lipinski's Rule of Five, 5,7,8,4'-Tetrahydroxy-3-methoxyflavone has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5,7,8,4'-Tetrahydroxy-3-methoxyflavone?
The CAS number of 5,7,8,4'-Tetrahydroxy-3-methoxyflavone is 86749-50-0.
What is the molecular formula of 5,7,8,4'-Tetrahydroxy-3-methoxyflavone?
The molecular formula of 5,7,8,4'-Tetrahydroxy-3-methoxyflavone is C16H12O7.
What is the molecular weight of 5,7,8,4'-Tetrahydroxy-3-methoxyflavone?
The molecular weight of 5,7,8,4'-Tetrahydroxy-3-methoxyflavone is 316.06 g/mol.
Where can I buy 5,7,8,4'-Tetrahydroxy-3-methoxyflavone?
You can request a quote for 5,7,8,4'-Tetrahydroxy-3-methoxyflavone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,7,8,4'-Tetrahydroxy-3-methoxyflavone?
Yes, KEHONG BIO provides custom synthesis services for 5,7,8,4'-Tetrahydroxy-3-methoxyflavone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.